SCHEMBL2398857

SCHEMBL2398857

Nc1ccc(Cl)cc1Oc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.73
CYP1A2 P05177 2/20 0.73
CYP2C9 P11712 2/20 0.73
CYP2C19 P33261 2/20 0.73
MAPT P10636 4/20 0.55
ALDH1A1 P00352 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
CYP2D6 P10635 1/20 0.55
HPGD P15428 1/20 0.55
KMT2A Q03164 1/20 0.55
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
PLAU P00749 1/20 0.45
TSHR P16473 2/20 0.45
ALOX15 P16050 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
NPSR1 Q6W5P4 2/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29682000 0.88 MAPT (0.69) CYP3A4CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL307310 0.85 CYP1A2 (1.00) CYP3A4CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL11522510 0.85 MAOA (0.61) CYP3A4CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL3790316 0.82 CYP1A2 (0.69) CYP3A4CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL1298828 0.81 ALDH1A1 (0.56) CYP3A4CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL2551468 0.81 MAPT (0.56) CYP3A4CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL5013387 0.80 MAOA (0.56) CYP3A4CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL7774904 0.80 MAOA (0.56) CYP3A4CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL30697305 0.80 ALDH1A1 (0.52) CYP3A4CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL5014782 0.80 ALDH1A1 (0.52) CYP3A4CYP1A2CYP2C9CYP2C19MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116789574-B Preparation method and application of camphorsulfonamide compound containing diphenyl ether group 南京林业大学 2024-07-30 CN claimed
US-4288362-A Monoazo pigments containing a quinazo linonylacetoacetanilide coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-09-08 US claimed
US-20250129258-A1 AQUEOUS INK, INK CARTRIDGE AND INK JET RECORDING METHOD CANON KK (JP) 2025-04-24 US disclosed
US-12215240-B2 Aqueous ink, ink cartridge and ink jet recording method CANON KABUSHIKI KAISHA (JP) 2025-02-04 US disclosed
CN-116789574-B Preparation method and application of camphorsulfonamide compound containing diphenyl ether group 南京林业大学 2024-07-30 CN disclosed
CN-116789574-A Preparation method and application of camphorsulfonamide compound containing diphenyl ether group 南京林业大学 2023-09-22 CN disclosed
CN-112852220-B Aqueous ink, ink cartridge, and ink jet recording method 佳能株式会社 2023-01-31 CN disclosed
CN-112852220-A Aqueous ink, ink cartridge, and ink jet recording method 佳能株式会社 2021-05-28 CN disclosed
US-20210139723-A1 AQUEOUS INK, INK CARTRIDGE AND INK JET RECORDING METHOD CANON KABUSHIKI KAISHA (JP) 2021-05-13 US disclosed
EP-1765768-B1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2013-11-06 EP disclosed
CN-102702194-A Anti-viral compounds ABBOTT LAB 2012-10-03 CN disclosed
WO-2006005909-A1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2006-01-19 WO disclosed
EP-0008627-B1 QUINAZOLINE DERIVATIVES, AZO DYES DERIVED FROM THE QUINAZOLINES AND THEIR USE AS PIGMENTS BAYER AG (DE) 1984-10-03 EP disclosed
US-4421601-A LACQUERS, INKS, PAINTS, TEXTILES, PAPER BAYER AKTIENGESELLSCHAFT (DE) 1983-12-20 US disclosed
US-4288362-A Monoazo pigments containing a quinazo linonylacetoacetanilide coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-09-08 US disclosed
US-4260540-A SPIN DYEING POLYACRYLONITRILE BAYER AKTIENGESELLSCHAFT (DE) 1981-04-07 US disclosed
US-4246401-A Axomethine pigments BAYER AKTIENGESELLSCHAFT (DE) 1981-01-20 US disclosed
US-4225489-A Heterocyclic azo dyes and pigments containing 4-quinazolinone moieties BAYER AKTIENGESELLSCHAFT (DE) 1980-09-30 US disclosed
EP-0008627-A2 Quinazoline derivatives, azo dyes derived from the quinazolines and their use as pigments BAYER AG (DE) 1980-03-19 EP disclosed
US-4014863-A LACQUERS, PRINTING INKS, PAINTS BAYER AKTIENGESELLSCHAFT (DT) 1977-03-29 US disclosed